| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2010 | 25 | Yes |
Popular Name: 4-[(S)-imidazol-1-yl(phenyl)methyl]-N-phenyl-aniline 4-[(S)-imidazol-1-yl(phenyl)meth…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 5.16 | 13.93 | -35.43 | 2 | 3 | 1 | 31 | 326.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.16 | 13.08 | -7.13 | 1 | 3 | 0 | 30 | 325.415 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CP26A-1-E | Cytochrome P450 26A1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5000 | 0.30 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CP26A_HUMAN | O43174 | Cytochrome P450 26A1, Human | 5000 | 0.30 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Vitamins |
